3WC
Summary
| Name: | 4-METHYL-2-(PIPERAZIN-1-YL) QUINOLINE |
| Formula: | C14 H17 N3 |
| Formal charge: | 0 |
| Formula weight: | 227.305 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-methyl-2-(piperazin-1-yl)quinoline |
| OpenEye OEToolkits | 1.9.2 | 4-methyl-2-piperazin-1-yl-quinoline |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n1c3c(c(cc1N2CCNCC2)C)cccc3 |
| InChI | InChI | 1.03 | InChI=1S/C14H17N3/c1-11-10-14(17-8-6-15-7-9-17)16-13-5-3-2-4-12(11)13/h2-5,10,15H,6-9H2,1H3 |
| InChIKey | InChI | 1.03 | LCRABWZMGNEZJV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cc(nc2ccccc12)N3CCNCC3 |
| SMILES | CACTVS | 3.385 | Cc1cc(nc2ccccc12)N3CCNCC3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | Cc1cc(nc2c1cccc2)N3CCNCC3 |
| SMILES | OpenEye OEToolkits | 1.9.2 | Cc1cc(nc2c1cccc2)N3CCNCC3 |
